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(3S,4S)-methyl 4-(4-methylphenylsulfonamido)-5-oxo-3,5-diphenylpentanoate
SpectraBase Compound ID 21ZEpWxrXnS
InChI InChI=1S/C25H25NO5S/c1-18-13-15-21(16-14-18)32(29,30)26-24(25(28)20-11-7-4-8-12-20)22(17-23(27)31-2)19-9-5-3-6-10-19/h3-16,22,24,26H,17H2,1-2H3/t22-,24-/m0/s1
InChIKey FLIFZOQJQHJIJJ-UPVQGACJSA-N
Mol Weight 451.54 g/mol
Molecular Formula C25H25NO5S
Exact Mass 451.145344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9IwO2Z0iLLw
Name (3S,4S)-methyl 4-(4-methylphenylsulfonamido)-5-oxo-3,5-diphenylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25NO5S
InChI InChI=1S/C25H25NO5S/c1-18-13-15-21(16-14-18)32(29,30)26-24(25(28)20-11-7-4-8-12-20)22(17-23(27)31-2)19-9-5-3-6-10-19/h3-16,22,24,26H,17H2,1-2H3/t22-,24-/m0/s1
InChIKey FLIFZOQJQHJIJJ-UPVQGACJSA-N
Literature Reference DOI 10.1002/adsc.201200987
Molecular Weight 451.537 g/mol
SMILES N([C@](C(c1ccccc1)=O)([C@@](CC(OC)=O)(c1ccccc1)[H])[H])S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0btc-5908000000-fbf3147b7c335c74936f
Source of Spectrum ASC-355-653/SM10-syn_7b
Wiley ID 1761946